3-[1,3-bis(oxidanylidene)-5-[[(2S)-2-phenylbutanoyl]amino]isoindol-2-yl]propanoate

Systemtic Name: 3-[1,3-bis(oxidanylidene)-5-[[(2S)-2-phenylbutanoyl]amino]isoindol-2-yl]propanoate Openeye Name: 3-[1,3-dioxo-5-[[(2S)-2-phenylbutanoyl]amino]isoindolin-2-yl]propanoate CAS Name: 3-[1,3-dioxo-5-[[(2S)-1-oxo-2-phenylbutyl]amino]-2-isoindolyl]propanoate IUPAC Name: 3-[1,3-dioxo-5-[[(2S)-2-phenylbutanoyl]amino]isoindol-2-yl]propanoate Traditional Name: 3-[1,3-diketo-5-[[(2S)-2-phenylbutanoyl]amino]isoindolin-2-yl]propionate Formula: C21H19N2O5- MolecularWeight: 379.38596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)CCC(=O)[O-]

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)CCC(=O)[O-]

InChI

InChI=1S/C21H20N2O5/c1-2-15(13-6-4-3-5-7-13)19(26)22-14-8-9-16-17(12-14)21(28)23(20(16)27)11-10-18(24)25/h3-9,12,15H,2,10-11H2,1H3,(H,22,26)(H,24,25)/p-1/t15-/m0/s1